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5876-52-8 | 5,6-DIIODOBENZO(1,3)DIOXOLE
CAS No: 5876-52-8 Catalog No: AG00E8YP MDL No:
Product Description
Catalog Number:
AG00E8YP
Chemical Name:
5,6-DIIODOBENZO(1,3)DIOXOLE
CAS Number:
5876-52-8
Molecular Formula:
C7H4I2O2
Molecular Weight:
373.9144
IUPAC Name:
5,6-diiodo-1,3-benzodioxole
InChI:
InChI=1S/C7H4I2O2/c8-4-1-6-7(2-5(4)9)11-3-10-6/h1-2H,3H2
InChI Key:
BXUOIEPSOIEXIN-UHFFFAOYSA-N
SMILES:
Ic1cc2OCOc2cc1I
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
373.83g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
373.916g/mol
Monoisotopic Mass:
373.83g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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